(4-methoxycarbonylphenyl) (3S)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl) (3S)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxylate Openeye Name: (4-methoxycarbonylphenyl) (3S)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxylate CAS Name: (3S)-1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxylic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) (3S)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxylate Traditional Name: (3S)-1-(4-methoxyphenyl)sulfonylnipecotic acid (4-carbomethoxyphenyl) ester Formula: C21H23NO7S MolecularWeight: 433.47482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)OC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@@H](C2)C(=O)OC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H23NO7S/c1-27-17-9-11-19(12-10-17)30(25,26)22-13-3-4-16(14-22)21(24)29-18-7-5-15(6-8-18)20(23)28-2/h5-12,16H,3-4,13-14H2,1-2H3/t16-/m0/s1